| Phytochemical Name : Senkyunolide A |
| PCNDIDS0076 |
| Pubchem CID : 3085257 |
| Molecular formula: C12H16O2 |
| Canonical SMILES : CCCCC1C2=C(C=CCC2)C(=O)O1 |
Synonymes : Senkyunolide A|Senkyunolide|63038-10-8|Sedanenolide|(S)-Sedanenolide|(-)-Sedanenolide|UNII-74QZK813SO|74QZK813SO|(S)-3-Butyl-4,5-dihydroisobenzofuran-1(3H)-one|1(3H)-Isobenzofuranone, 3-butyl-4,5-dihydro-, (S)-|(3S)-3-butyl-4,5-dihydro-3H-2-benzofuran-1-one|DTXSID40212322|1(3H)-Isobenzofuranone, 3-butyl-4,5-dihydro-, (3S)-|(3S)-3-BUTYL-4,5-DIHYDRO-2-BENZOFURAN-1(3H)-ONE|Senkyunolide-A|SENKYUNOLIDE A 98%|(3S)-3-Butyl-4,5-dihydro-1(3H)-isobenzofuranone|3-butyl-4,5-dihydrophthalide|SCHEMBL13053469|DTXCID40134813|CHEBI:179916|HY-N0743|MFCD16660665|s9513|AKOS032949093|MS-23041|CS-0009775|C17853|(3S)-3-butyl-4,5-dihydro-3H-2-benzouran-1-one|Q27266299|(3S)-3-butyl-1,3,4,5-tetrahydro-2-benzofuran-1-one|1(3H)-Isobenzofuranone, 3-butyl-4,5-dihydro-, (-)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.680 |
| Log Po/w (XLOGP3) : 2.690 |
| Log Po/w (WLOGP) : 2.750 |
| Log Po/w (MLOGP) : 2.560 |
| Log Po/w (SILICOS-IT) : 2.890 |
| Consensus Log Po/w : 2.710 |